1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine

C14H10ClF2N3 — CID 103593159

IUPAC1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
SMILESCc1cc2c(cc1F)nc(N)n2-c1c(F)cccc1Cl
InChIInChI=1S/C14H10ClF2N3/c1-7-5-12-11(6-10(7)17)19-14(18)20(12)13-8(15)3-2-4-9(13)16/h2-6H,1H3,(H2,18,19)
InChIKeyVIXWWCAIFDIRDR-UHFFFAOYSA-N
MW293.70 g/mol
LogP3.85
Rot. Bonds1

About 1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine

1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine (PubChem CID 103593159) has the molecular formula C14H10ClF2N3 and a molecular weight of 293.70 g/mol. Its IUPAC name is 1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine.

Molecular Properties

Compound Name1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
PubChem CID103593159
Molecular FormulaC14H10ClF2N3
Molecular Weight293.70 g/mol
Exact Mass293.05
IUPAC Name1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
SMILESCc1cc2c(cc1F)nc(N)n2-c1c(F)cccc1Cl
InChIInChI=1S/C14H10ClF2N3/c1-7-5-12-11(6-10(7)17)19-14(18)20(12)13-8(15)3-2-4-9(13)16/h2-6H,1H3,(H2,18,19)
InChIKeyVIXWWCAIFDIRDR-UHFFFAOYSA-N
XLogP3.85
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.70
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-dichlorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592709
1-(2-chloro-4-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592726
5-fluoro-1-(3-fluorophenyl)-6-methylbenzimidazol-2-amine
CID 103592659
1-(3,5-dimethylphenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592692
1-(3,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592691
4-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)-3-chlorobenzonitrile
CID 107809092
1-(2,5-dimethylphenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592661
1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592718
6-chloro-1-(2,6-difluoro-3-methylphenyl)benzimidazol-2-amine
CID 82820117
5-bromo-1-(2,6-difluorophenyl)benzimidazol-2-amine
CID 43661750
4-chloro-1-(2,6-difluoro-3-methylphenyl)benzimidazol-2-amine
CID 104837243
5-chloro-6-fluoro-1-(4-methylphenyl)benzimidazol-2-amine
CID 66077135

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine?
The IUPAC name of 1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine (CID 103593159) is 1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine.
What is the SMILES notation for 1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine?
The canonical SMILES for 1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine is Cc1cc2c(cc1F)nc(N)n2-c1c(F)cccc1Cl.
What is the InChIKey of 1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine?
The InChIKey is VIXWWCAIFDIRDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF2N3/c1-7-5-12-11(6-10(7)17)19-14(18)20(12)13-8(15)3-2-4-9(13)16/h2-6H,1H3,(H2,18,19).
What are the key properties of 1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine?
1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine has a molecular weight of 293.70 g/mol, XLogP of 3.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine is sourced from PubChem (CID 103593159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).